Bicarbonate Ion → 3-chloro-1-(9H-tribenz[b,d,f]azepine-9-yl)propan-1-one
Reaction equation
[C:33](=[O:34])([OH:35])[O-:36].[CH3:26][CH2:27][N:28]([CH2:29][CH3:30])[CH2:31][CH3:32].[CH3:38][c:39]1[cH:40][cH:41][cH:42][cH:43][cH:44]1.[Cl:20][CH2:21][CH2:22][C:23](=[O:24])[Cl:25].[Na+:37].[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:11]1-[c:10]1[c:9]([cH:15][cH:14][cH:13][cH:12]1)[NH:8][c:7]1[c:6]-2[cH:19][cH:18][cH:17][cH:16]1>>[cH:1]1[cH:2][cH:3][cH:4][c:5]2[c:11]1-[c:10]1[c:9]([cH:15][cH:14][cH:13][cH:12]1)[N:8]([C:23]([CH2:22][CH2:21][Cl:20])=[O:24])[c:7]1[c:6]-2[cH:19][cH:18][cH:17][cH:16]1Participants
7
Sources & evidence
- ORD record
- ord-f884efddee9d494b82523ed06915fb58
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (1/10)
Reaction notes
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